5-chloranyl-3-propan-2-yl-2-propyl-3-(trifluoromethyl)benzimidazol-3-ium-4-amine

Systemtic Name: 5-chloranyl-3-propan-2-yl-2-propyl-3-(trifluoromethyl)benzimidazol-3-ium-4-amine Openeye Name: 5-chloro-3-isopropyl-2-propyl-3-(trifluoromethyl)benzimidazol-3-ium-4-amine CAS Name: 5-chloro-3-propan-2-yl-2-propyl-3-(trifluoromethyl)-4-benzimidazol-3-iumamine IUPAC Name: 5-chloro-3-propan-2-yl-2-propyl-3-(trifluoromethyl)benzimidazol-3-ium-4-amine Traditional Name: [5-chloro-3-isopropyl-2-propyl-3-(trifluoromethyl)benzimidazol-3-ium-4-yl]amine Formula: C14H18ClF3N3+ MolecularWeight: 320.76103

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C([N+]1(C(C)C)C(F)(F)F)C(=C(C=C2)Cl)N

Isomeric SMILES

CCCC1=NC2=C([N+]1(C(C)C)C(F)(F)F)C(=C(C=C2)Cl)N

InChI

InChI=1S/C14H18ClF3N3/c1-4-5-11-20-10-7-6-9(15)12(19)13(10)21(11,8(2)3)14(16,17)18/h6-8H,4-5,19H2,1-3H3/q+1